2-(3,4-dihydro-1H-isoquinolin-2-yl)-6-naphthalen-2-yl-5-sulfanylidene-1H-pyrimido[4,5-d]pyrimidin-4-one

Systemtic Name: 2-(3,4-dihydro-1H-isoquinolin-2-yl)-6-naphthalen-2-yl-5-sulfanylidene-1H-pyrimido[4,5-d]pyrimidin-4-one Openeye Name: 2-(3,4-dihydro-1H-isoquinolin-2-yl)-6-(2-naphthyl)-5-thioxo-1H-pyrimido[4,5-d]pyrimidin-4-one CAS Name: 2-(3,4-dihydro-1H-isoquinolin-2-yl)-6-(2-naphthalenyl)-5-sulfanylidene-1H-pyrimido[4,5-d]pyrimidin-4-one IUPAC Name: 2-(3,4-dihydro-1H-isoquinolin-2-yl)-6-naphthalen-2-yl-5-sulfanylidene-1H-pyrimido[4,5-d]pyrimidin-4-one Traditional Name: 2-(3,4-dihydro-1H-isoquinolin-2-yl)-6-(2-naphthyl)-5-thioxo-1H-pyrimido[4,5-d]pyrimidin-4-one Formula: C25H19N5OS MolecularWeight: 437.51626

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC2=CC=CC=C21)C3=NC(=O)C4=C(N3)N=CN(C4=S)C5=CC6=CC=CC=C6C=C5

Isomeric SMILES

C1CN(CC2=CC=CC=C21)C3=NC(=O)C4=C(N3)N=CN(C4=S)C5=CC6=CC=CC=C6C=C5

InChI

InChI=1S/C25H19N5OS/c31-23-21-22(27-25(28-23)29-12-11-17-6-2-4-8-19(17)14-29)26-15-30(24(21)32)20-10-9-16-5-1-3-7-18(16)13-20/h1-10,13,15H,11-12,14H2,(H,27,28,31)